N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine

C14H24N4 — CID 114080351

IUPACN-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine
SMILESCc1nccnc1C(C)NCC(C)N1CCCC1
InChIInChI=1S/C14H24N4/c1-11(18-8-4-5-9-18)10-17-13(3)14-12(2)15-6-7-16-14/h6-7,11,13,17H,4-5,8-10H2,1-3H3
InChIKeyLPNZQIFKWCFMCD-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.92
Rot. Bonds5

About N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine

N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine (PubChem CID 114080351) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine
PubChem CID114080351
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine
SMILESCc1nccnc1C(C)NCC(C)N1CCCC1
InChIInChI=1S/C14H24N4/c1-11(18-8-4-5-9-18)10-17-13(3)14-12(2)15-6-7-16-14/h6-7,11,13,17H,4-5,8-10H2,1-3H3
InChIKeyLPNZQIFKWCFMCD-UHFFFAOYSA-N
XLogP1.92
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-Methylpyrazin-2-yl)ethan-1-amine
CID 82418539
(1S)-1-(3-methylpyrazin-2-yl)ethan-1-amine dihydrochloride
CID 137952185
(1R)-1-(3-methylpyrazin-2-yl)ethan-1-amine dihydrochloride
CID 137952203
1-pyrazin-2-yl-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]ethanamine
CID 64190696
1-(3-methylpyrazin-2-yl)-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]ethanamine
CID 102612473
3,3,3-trifluoro-N-[1-(3-methylpyrazin-2-yl)ethyl]propan-1-amine
CID 102612905
N-[1-(3-methylpyrazin-2-yl)ethyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210712
2,2,3,3-tetrafluoro-N-[1-(3-methylpyrazin-2-yl)ethyl]propan-1-amine
CID 106289960
2,2,2-trifluoro-N-[1-(3-methylpyrazin-2-yl)ethyl]ethanamine
CID 108425621
2,2-difluoro-N-[1-(3-methylpyrazin-2-yl)ethyl]ethanamine
CID 108425962
1,1,1-trifluoro-N-methyl-2-(3-methylpyrazin-2-yl)propan-2-amine
CID 108426890
N-ethyl-1,1,1-trifluoro-2-(3-methylpyrazin-2-yl)propan-2-amine
CID 108426891

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine (CID 114080351) is N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine is Cc1nccnc1C(C)NCC(C)N1CCCC1.
What is the InChIKey of N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is LPNZQIFKWCFMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-11(18-8-4-5-9-18)10-17-13(3)14-12(2)15-6-7-16-14/h6-7,11,13,17H,4-5,8-10H2,1-3H3.
What are the key properties of N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine?
N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylpyrazin-2-yl)ethyl]-2-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 114080351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).